6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine

C15H19N3 — CID 62190210

IUPAC6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine
SMILESCCc1cc(NC)nc(CCc2ccccc2)n1
InChIInChI=1S/C15H19N3/c1-3-13-11-15(16-2)18-14(17-13)10-9-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3,(H,16,17,18)
InChIKeyAFAPMEZXMNQLFI-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.87
Rot. Bonds5

About 6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine

6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine (PubChem CID 62190210) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine
PubChem CID62190210
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine
SMILESCCc1cc(NC)nc(CCc2ccccc2)n1
InChIInChI=1S/C15H19N3/c1-3-13-11-15(16-2)18-14(17-13)10-9-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3,(H,16,17,18)
InChIKeyAFAPMEZXMNQLFI-UHFFFAOYSA-N
XLogP2.87
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine?
The IUPAC name of 6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine (CID 62190210) is 6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine is CCc1cc(NC)nc(CCc2ccccc2)n1.
What is the InChIKey of 6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine?
The InChIKey is AFAPMEZXMNQLFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-3-13-11-15(16-2)18-14(17-13)10-9-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3,(H,16,17,18).
What are the key properties of 6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine?
6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine has a molecular weight of 241.34 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-methyl-2-(2-phenylethyl)pyrimidin-4-amine is sourced from PubChem (CID 62190210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).